ethyl 2-{[1-(2-ethoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[1-(2-ethoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}benzoate
ethyl 2-{[1-(2-ethoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E540-1103 |
| Compound Name: | ethyl 2-{[1-(2-ethoxy-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-carbonyl]amino}benzoate |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C23 H26 N2 O5 |
| Smiles: | CCOC(CC1c2ccccc2CCN1C(Nc1ccccc1C(=O)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.604 |
| logD: | 4.6033 |
| logSw: | -4.2 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.12 |
| InChI Key: | DRBUCEULKRGGJO-FQEVSTJZSA-N |